1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine

C18H24N2 — CID 105140419

IUPAC1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine
SMILESCNC(c1ccc(C(C)(C)C)cc1)c1cccnc1C
InChIInChI=1S/C18H24N2/c1-13-16(7-6-12-20-13)17(19-5)14-8-10-15(11-9-14)18(2,3)4/h6-12,17,19H,1-5H3
InChIKeyUCNHUMURDXDMCZ-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.00
Rot. Bonds3

About 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine

1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine (PubChem CID 105140419) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine
PubChem CID105140419
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine
SMILESCNC(c1ccc(C(C)(C)C)cc1)c1cccnc1C
InChIInChI=1S/C18H24N2/c1-13-16(7-6-12-20-13)17(19-5)14-8-10-15(11-9-14)18(2,3)4/h6-12,17,19H,1-5H3
InChIKeyUCNHUMURDXDMCZ-UHFFFAOYSA-N
XLogP4.00
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-tert-butylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 43484460
N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine
CID 105173794
1-(4-tert-butylphenyl)-N-methyl-1-(2-methylthiophen-3-yl)methanamine
CID 102841861
1-(2-methoxy-3-pyridinyl)-N-methyl-1-[4-(trifluoromethyl)phenyl]methanamine
CID 105142640
N-methyl-1-(2-methyl-3-pyridinyl)-1-thiophen-2-ylmethanamine
CID 105100081
N-methyl-1-(2-methyl-3-pyridinyl)-1-quinolin-8-ylmethanamine
CID 105172443
1-(4-tert-butylphenyl)-1-(3-chloro-4-pyridinyl)-N-methylmethanamine
CID 105140506
N-[(4-tert-butylphenyl)-(4-fluorophenyl)methyl]-3-methylpyridin-2-amine
CID 71661923
N-[(4-tert-butylphenyl)-[4-(trifluoromethyl)phenyl]methyl]-3-methylpyridin-2-amine
CID 71661925
[(4-tert-butylphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203825
1-(4-tert-butylphenyl)-1-(2-chloro-4-methylphenyl)-N-methylmethanamine
CID 106857422
1-(4-tert-butylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 55085542

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine?
The IUPAC name of 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine (CID 105140419) is 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine?
The canonical SMILES for 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine is CNC(c1ccc(C(C)(C)C)cc1)c1cccnc1C.
What is the InChIKey of 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine?
The InChIKey is UCNHUMURDXDMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-13-16(7-6-12-20-13)17(19-5)14-8-10-15(11-9-14)18(2,3)4/h6-12,17,19H,1-5H3.
What are the key properties of 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine?
1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine has a molecular weight of 268.40 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylphenyl)-N-methyl-1-(2-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 105140419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).